ethyl 2-methyl-4-(4-nitrophenyl)-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: ethyl 2-methyl-4-(4-nitrophenyl)-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: ethyl 2-hydroxy-2-methyl-4-(4-nitrophenyl)-4-oxo-butanoate CAS Name: 2-hydroxy-2-methyl-4-(4-nitrophenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-methyl-4-(4-nitrophenyl)-4-oxobutanoate Traditional Name: 2-hydroxy-4-keto-2-methyl-4-(4-nitrophenyl)butyric acid ethyl ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CC(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C(C)(CC(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C13H15NO6/c1-3-20-12(16)13(2,17)8-11(15)9-4-6-10(7-5-9)14(18)19/h4-7,17H,3,8H2,1-2H3